{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2261723 -3.3240649 -5.3627044 ] [ -5.7475108 -8.5086002 3.5278883 ] [ -0.2997254 1.8103468 -1.3523807 ] [ -3.2057819 2.0163252 1.1448484 ] [ 0.767338 -0.8381538 -0.0673318 ] [ -0.3045425 0.9339106 -0.0085179 ] [ 9.0163949 7.9102361 2.118198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.623679713325638e-10 -5.32573906880189e-09 -8.591999613941292e-09 ] [ -9.208527431555504e-09 -1.36322803161742e-08 5.652300155053856e-09 ] [ -4.802130285399283e-10 2.900495318500094e-09 -2.166752739961139e-09 ] [ -5.136228811563804e-09 3.230509095369884e-09 1.834249340840287e-09 ] [ 1.22941100385143e-09 -1.342870422994679e-09 -1.078774357963814e-10 ] [ -4.87930873539984e-10 1.496289729237301e-09 -1.364718023831232e-11 ] [ 1.444585711268035e-08 1.267359534442817e-08 3.393727313825318e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.742444 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.682435235185323e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5630193 1.7919142 2.6068275 ] [ 2.6119816 1.6178335 4.9700561 ] [ 2.6988752 4.219392 3.056192 ] [ 1.3099652 3.6397941 4.9858572 ] [ 4.5647324 0.9973497 1.5956388 ] [ 4.0647689 3.2967963 1.2991438 ] [ 3.7318135 3.7393773 5.1952042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5630193e-10 1.7919142e-10 2.6068275e-10 ] [ 2.6119816e-10 1.6178335e-10 4.9700561e-10 ] [ 2.6988752e-10 4.219392e-10 3.056192e-10 ] [ 1.3099652e-10 3.6397941e-10 4.9858572e-10 ] [ 4.5647324e-10 9.973497e-11 1.5956388e-10 ] [ 4.0647689e-10 3.2967963e-10 1.2991438e-10 ] [ 3.7318135e-10 3.7393773e-10 5.1952042e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.71e-05 3.48e-05 2.39e-05 ] [ 4.55e-05 4.56e-05 -3.6e-05 ] [ 2.28e-05 -4.98e-05 1.2e-06 ] [ 2.26e-05 -3.06e-05 -1e-05 ] [ 2.2e-06 -6.2e-05 -2.33e-05 ] [ 7.3e-06 3.81e-05 1.79e-05 ] [ -5.32e-05 2.39e-05 2.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.546251883968001e-14 5.575574640383999e-14 3.829202123712e-14 ] [ 7.28990362464e-14 7.305925390848e-14 -5.76783583488e-14 ] [ 3.652962695424e-14 -7.978839571583999e-14 1.92261194496e-15 ] [ 3.620919163008e-14 -4.902660459647999e-14 -1.6021766208e-14 ] [ 3.52478856576e-15 -9.93349504896e-14 -3.733071526464e-14 ] [ 1.169588933184e-14 6.104292925248e-14 2.867896151232001e-14 ] [ -8.523579622656e-14 3.829202123712e-14 4.197702746496e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.748666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.324302757798786e-18 } }